2-({[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]-1,3-oxazole-4-carboxamide
Chemical Structure Depiction of
2-({[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]-1,3-oxazole-4-carboxamide
2-({[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]-1,3-oxazole-4-carboxamide
Compound characteristics
| Compound ID: | V013-8316 |
| Compound Name: | 2-({[2-(3-methylbutanoyl)-1-(4-methylphenyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]oxy}methyl)-N-[(oxolan-2-yl)methyl]-1,3-oxazole-4-carboxamide |
| Molecular Weight: | 531.65 |
| Molecular Formula: | C31 H37 N3 O5 |
| Smiles: | CC(C)CC(N1CCc2ccc(cc2C1c1ccc(C)cc1)OCc1nc(co1)C(NCC1CCCO1)=O)=O |
| Stereo: | MIXTURE OF STEREOISOMERS |
| logP: | 4.7877 |
| logD: | 4.7877 |
| logSw: | -4.4933 |
| Hydrogen bond acceptors count: | 8 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 74.307 |
| InChI Key: | YLHLOAHBKMWALN-UHFFFAOYSA-N |